(3-aminonaphthalen-2-yl)methanol

C11H11NO — CID 10374898

IUPAC(3-aminonaphthalen-2-yl)methanol
SMILESNc1cc2ccccc2cc1CO
InChIInChI=1S/C11H11NO/c12-11-6-9-4-2-1-3-8(9)5-10(11)7-13/h1-6,13H,7,12H2
InChIKeyJISDTJXWUKAFFL-UHFFFAOYSA-N
MW173.21 g/mol
LogP1.91
Rot. Bonds1

About (3-aminonaphthalen-2-yl)methanol

(3-aminonaphthalen-2-yl)methanol (PubChem CID 10374898) has the molecular formula C11H11NO and a molecular weight of 173.21 g/mol. Its IUPAC name is (3-aminonaphthalen-2-yl)methanol.

Molecular Properties

Compound Name(3-aminonaphthalen-2-yl)methanol
PubChem CID10374898
Molecular FormulaC11H11NO
Molecular Weight173.21 g/mol
Exact Mass173.08
IUPAC Name(3-aminonaphthalen-2-yl)methanol
SMILESNc1cc2ccccc2cc1CO
InChIInChI=1S/C11H11NO/c12-11-6-9-4-2-1-3-8(9)5-10(11)7-13/h1-6,13H,7,12H2
InChIKeyJISDTJXWUKAFFL-UHFFFAOYSA-N
XLogP1.91
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze (3-aminonaphthalen-2-yl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3-aminonaphthalen-2-yl)methanol?
The IUPAC name of (3-aminonaphthalen-2-yl)methanol (CID 10374898) is (3-aminonaphthalen-2-yl)methanol.
What is the SMILES notation for (3-aminonaphthalen-2-yl)methanol?
The canonical SMILES for (3-aminonaphthalen-2-yl)methanol is Nc1cc2ccccc2cc1CO.
What is the InChIKey of (3-aminonaphthalen-2-yl)methanol?
The InChIKey is JISDTJXWUKAFFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO/c12-11-6-9-4-2-1-3-8(9)5-10(11)7-13/h1-6,13H,7,12H2.
What are the key properties of (3-aminonaphthalen-2-yl)methanol?
(3-aminonaphthalen-2-yl)methanol has a molecular weight of 173.21 g/mol, XLogP of 1.91, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminonaphthalen-2-yl)methanol is sourced from PubChem (CID 10374898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).